Are Energy and Forces Really Enough? Using Structure to Evaluate the Accuracy and Transferability of Machine Learning Potentials of Biomolecules

Research Square 2026 Preprint Open access

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Authors: Lejla S. Biberic, Nisarg Joshi, Jim Pfaendtner
DOI: 10.21203/rs.3.rs-8319683/v1
Cited by: 0

Fields of Study & Subjects

Machine Learning in Materials Science Advanced Chemical Physics Studies Computational Drug Discovery Methods

Publication details

Journal / source
Research Square
Publication date
14 January 2026
Document type
Preprint